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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=194",
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"results": [
{
"id": "jvasp-18777",
"created_at": "2022-09-04T14:37:03.589098Z",
"updated_at": "2022-09-04T14:37:03.589119Z",
"structure_string": "Sc1 Sn1 Pt2\n1.0\n4.053857 0.000000 2.340495\n1.351286 3.822013 2.340495\n-0.000000 -0.000000 4.680991\nSc Sn Pt\n1 1 2\ndirect\n0.500001 0.500000 0.500001 Sc\n0.000000 0.000000 0.000000 Sn\n0.750002 0.749999 0.750001 Pt\n0.250001 0.250000 0.250000 Pt\n",
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"volume": 72.52677909048663,
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{
"id": "jvasp-17266",
"created_at": "2022-09-04T14:37:45.597193Z",
"updated_at": "2022-09-04T14:37:45.597222Z",
"structure_string": "Sc2 Si2 Pt4\n1.0\n3.702689 0.000000 0.000000\n-1.851345 4.989816 -0.000000\n0.000000 0.000000 7.016519\nSc Si Pt\n2 2 4\ndirect\n0.952837 0.905672 0.250000 Sc\n0.047165 0.094329 0.750000 Sc\n0.233705 0.467408 0.250000 Si\n0.766297 0.532593 0.750000 Si\n0.363327 0.726653 0.547439 Pt\n0.636675 0.273348 0.452562 Pt\n0.636675 0.273348 0.047438 Pt\n0.363327 0.726653 0.952562 Pt\n",
"nsites": 8,
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"elements": [
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"density": 11.86678286107016,
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"volume": 129.63535840301867,
"volume_molar": 9.75852969720034,
"formula_full": "Sc2 Si2 Pt4",
"formula_reduced": "ScSiPt2",
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"spacegroup": 63
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{
"id": "jvasp-21914",
"created_at": "2022-09-04T14:38:17.051264Z",
"updated_at": "2022-09-04T14:38:17.051291Z",
"structure_string": "Sc5 Si7 Pt9\n1.0\n5.024435 -8.702577 0.000000\n5.024435 8.702577 -0.000000\n-0.000000 -0.000000 3.913793\nSc Si Pt\n5 7 9\ndirect\n0.333333 0.666668 0.000000 Sc\n0.666668 0.333333 0.500000 Sc\n0.229873 0.125143 0.500000 Sc\n0.895270 0.770128 0.500000 Sc\n0.874858 0.104731 0.500000 Sc\n0.000000 0.000000 0.000000 Si\n0.683358 0.572121 0.000000 Si\n0.888764 0.316643 0.000000 Si\n0.427880 0.111237 0.000000 Si\n0.144678 0.717363 0.500000 Si\n0.572687 0.855323 0.500000 Si\n0.282637 0.427314 0.500000 Si\n0.159700 0.876078 0.000000 Pt\n0.549476 0.602062 0.500000 Pt\n0.397939 0.947414 0.500000 Pt\n0.052587 0.450524 0.500000 Pt\n0.651916 0.086289 0.000000 Pt\n0.913712 0.565627 0.000000 Pt\n0.434374 0.348085 0.000000 Pt\n0.716379 0.840301 0.000000 Pt\n0.123923 0.283622 0.000000 Pt\n",
"nsites": 21,
"nelements": 3,
"elements": [
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"Si",
"Pt"
],
"chemical_system": "Pt-Sc-Si",
"density": 10.562611707552248,
"density_atomic": 0.06135590129345546,
"volume": 342.26536579685074,
"volume_molar": 9.81509623857869,
"formula_full": "Sc5 Si7 Pt9",
"formula_reduced": "Sc5Si7Pt9",
"formula_anonymous": "A5B7C9",
"energy_above_hull": 3.485015669047619,
"spacegroup": 174
},
{
"id": "jvasp-120458",
"created_at": "2022-09-04T14:38:50.894479Z",
"updated_at": "2022-09-04T14:38:50.894505Z",
"structure_string": "Sc12 Si12 Pt4\n1.0\n4.038989 -0.000000 0.000000\n0.000000 10.253170 0.000000\n-0.000000 0.000000 11.718808\nSc Si Pt\n12 12 4\ndirect\n0.250000 0.875689 0.020393 Sc\n0.750000 0.157762 0.698938 Sc\n0.750000 0.342238 0.198938 Sc\n0.250000 0.842238 0.301063 Sc\n0.750000 0.420154 0.900398 Sc\n0.750000 0.079846 0.400398 Sc\n0.250000 0.657762 0.801063 Sc\n0.250000 0.920154 0.599602 Sc\n0.750000 0.375689 0.479607 Sc\n0.750000 0.124311 0.979607 Sc\n0.250000 0.624311 0.520393 Sc\n0.250000 0.579846 0.099602 Sc\n0.750000 0.747809 0.655705 Si\n0.750000 0.686268 0.957164 Si\n0.750000 0.813732 0.457164 Si\n0.250000 0.313732 0.042836 Si\n0.250000 0.186268 0.542836 Si\n0.750000 0.752191 0.155705 Si\n0.250000 0.482420 0.324535 Si\n0.250000 0.247809 0.844295 Si\n0.750000 0.517580 0.675465 Si\n0.750000 0.982420 0.175465 Si\n0.250000 0.017580 0.824535 Si\n0.250000 0.252191 0.344295 Si\n0.750000 0.613501 0.322970 Pt\n0.250000 0.386499 0.677030 Pt\n0.250000 0.113501 0.177030 Pt\n0.750000 0.886499 0.822970 Pt\n",
"nsites": 28,
"nelements": 3,
"elements": [
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"Si",
"Pt"
],
"chemical_system": "Pt-Sc-Si",
"density": 5.669092606914862,
"density_atomic": 0.05769574212541807,
"volume": 485.30444307543615,
"volume_molar": 10.437755955906013,
"formula_full": "Sc12 Si12 Pt4",
"formula_reduced": "Sc3Si3Pt",
"formula_anonymous": "AB3C3",
"energy_above_hull": 3.0927247071428567,
"spacegroup": 62
},
{
"id": "jvasp-19882",
"created_at": "2022-09-04T14:36:46.957874Z",
"updated_at": "2022-09-04T14:36:46.957901Z",
"structure_string": "Sc1 Pt1\n1.0\n3.293169 -0.000000 -0.000000\n0.000000 3.293169 0.000000\n0.000000 0.000000 3.293169\nSc Pt\n1 1\ndirect\n0.500000 0.500000 0.500000 Sc\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sc",
"Pt"
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"chemical_system": "Pt-Sc",
"density": 11.160676003397183,
"density_atomic": 0.05599998877889841,
"volume": 35.71429287060194,
"volume_molar": 10.753824940531466,
"formula_full": "Sc1 Pt1",
"formula_reduced": "ScPt",
"formula_anonymous": "AB",
"energy_above_hull": 1.0919133250000002,
"spacegroup": 221
},
{
"id": "jvasp-14738",
"created_at": "2022-09-04T14:36:58.619248Z",
"updated_at": "2022-09-04T14:36:58.619270Z",
"structure_string": "Sc1 Pt3\n1.0\n4.005426 0.000000 -0.000000\n0.000000 4.005426 -0.000000\n0.000000 0.000000 4.005426\nSc Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500001 0.500001 0.000000 Pt\n0.500001 0.000000 0.500001 Pt\n0.000000 0.500001 0.500001 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sc",
"Pt"
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"chemical_system": "Pt-Sc",
"density": 16.284964305170607,
"density_atomic": 0.06224634472770885,
"volume": 64.26080145746144,
"volume_molar": 9.674689793181148,
"formula_full": "Sc1 Pt3",
"formula_reduced": "ScPt3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.3441873625000005,
"spacegroup": 221
},
{
"id": "jvasp-16883",
"created_at": "2022-09-04T14:38:14.798736Z",
"updated_at": "2022-09-04T14:38:14.798753Z",
"structure_string": "Zr6 Sb2 Pt1\n1.0\n3.927858 -6.803250 0.000000\n3.927858 6.803250 -0.000000\n0.000000 -0.000000 3.726017\nZr Sb Pt\n6 2 1\ndirect\n0.000000 0.405896 0.000000 Zr\n0.594104 0.594104 0.000000 Zr\n0.405896 0.000000 0.000000 Zr\n0.000000 0.748382 0.500000 Zr\n0.251619 0.251619 0.500000 Zr\n0.748382 0.000000 0.500000 Zr\n0.666667 0.333333 0.500000 Sb\n0.333333 0.666667 0.500000 Sb\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Zr",
"Sb",
"Pt"
],
"chemical_system": "Pt-Sb-Zr",
"density": 8.221594841316618,
"density_atomic": 0.04519552885232063,
"volume": 199.1347424964999,
"volume_molar": 13.32463832800307,
"formula_full": "Zr6 Sb2 Pt1",
"formula_reduced": "Zr6Sb2Pt",
"formula_anonymous": "AB2C6",
"energy_above_hull": 4.090844511111111,
"spacegroup": 189
},
{
"id": "jvasp-56386",
"created_at": "2022-09-04T14:36:46.512283Z",
"updated_at": "2022-09-04T14:36:46.512297Z",
"structure_string": "Yb1 Sb1 Pt1\n1.0\n4.045641 0.000000 2.335751\n1.348546 3.814266 2.335751\n0.000000 0.000000 4.671503\nYb Sb Pt\n1 1 1\ndirect\n0.500000 0.500001 0.499999 Yb\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 3,
"nelements": 3,
"elements": [
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"Sb",
"Pt"
],
"chemical_system": "Pt-Sb-Yb",
"density": 11.28463202745954,
"density_atomic": 0.04161657199519698,
"volume": 72.08666779056752,
"volume_molar": 14.470535345138527,
"formula_full": "Yb1 Sb1 Pt1",
"formula_reduced": "YbSbPt",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6899660666666667,
"spacegroup": 216
},
{
"id": "jvasp-1492",
"created_at": "2022-09-04T14:36:57.432646Z",
"updated_at": "2022-09-04T14:36:57.432668Z",
"structure_string": "Y1 Sb1 Pt1\n1.0\n4.052454 0.000000 2.339685\n1.350818 3.820691 2.339685\n0.000000 0.000000 4.679372\nY Sb Pt\n1 1 1\ndirect\n0.500000 0.500000 0.500001 Y\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 3,
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"elements": [
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"Sb",
"Pt"
],
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"density": 9.299506112142378,
"density_atomic": 0.04140699114872512,
"volume": 72.45153334673937,
"volume_molar": 14.543777736396612,
"formula_full": "Y1 Sb1 Pt1",
"formula_reduced": "YSbPt",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7011476499999998,
"spacegroup": 216
},
{
"id": "jvasp-7824",
"created_at": "2022-09-04T14:36:46.429733Z",
"updated_at": "2022-09-04T14:36:46.429757Z",
"structure_string": "Tm1 Sb1 Pt1\n1.0\n4.014301 -0.000000 2.317658\n1.338101 3.784719 2.317658\n0.000000 0.000000 4.635316\nTm Sb Pt\n1 1 1\ndirect\n0.500000 0.500000 0.500001 Tm\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 3,
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"elements": [
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],
"chemical_system": "Pt-Sb-Tm",
"density": 11.454185371698841,
"density_atomic": 0.04259889505336658,
"volume": 70.42436185825225,
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"formula_full": "Tm1 Sb1 Pt1",
"formula_reduced": "TmSbPt",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2473172499999998,
"spacegroup": 216
},
{
"id": "jvasp-113001",
"created_at": "2022-09-04T14:38:45.352261Z",
"updated_at": "2022-09-04T14:38:45.352287Z",
"structure_string": "Tm10 Sb2 Pt4\n1.0\n6.809269 -0.100791 -5.224071\n-1.716026 6.590262 -5.224071\n0.079106 0.100791 8.582005\nTm Sb Pt\n10 2 4\ndirect\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 -0.000000 Tm\n0.795175 0.295174 0.811012 Tm\n0.204826 0.704826 0.188987 Tm\n0.484160 0.984161 0.188987 Tm\n0.295174 0.484161 0.500000 Tm\n0.015839 0.204826 0.500000 Tm\n0.515840 0.015839 0.811012 Tm\n0.704826 0.515839 0.500000 Tm\n0.984161 0.795174 0.500000 Tm\n0.250000 0.250000 -0.000000 Sb\n0.750000 0.750000 -0.000000 Sb\n0.140519 0.640519 0.781039 Pt\n0.859481 0.359481 0.218960 Pt\n0.640519 0.859480 0.500000 Pt\n0.359481 0.140519 0.500000 Pt\n",
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"elements": [
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"density": 11.526049522450036,
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"volume": 390.8860040640541,
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"formula_full": "Tm10 Sb2 Pt4",
"formula_reduced": "Tm5SbPt2",
"formula_anonymous": "AB2C5",
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"spacegroup": 140
},
{
"id": "jvasp-120506",
"created_at": "2022-09-04T14:38:52.924678Z",
"updated_at": "2022-09-04T14:38:52.924713Z",
"structure_string": "Sb4 Te4 Pt4\n1.0\n6.662989 -0.000000 0.000000\n0.000000 6.662989 0.000000\n0.000000 0.000000 6.662989\nSb Te Pt\n4 4 4\ndirect\n0.127157 0.872843 0.372843 Sb\n0.872843 0.372843 0.127157 Sb\n0.372843 0.127157 0.872843 Sb\n0.627157 0.627157 0.627157 Sb\n0.872690 0.127310 0.627310 Te\n0.127310 0.627310 0.872690 Te\n0.627310 0.872690 0.127310 Te\n0.372690 0.372690 0.372690 Te\n0.506073 0.493927 0.993927 Pt\n0.493927 0.993927 0.506073 Pt\n0.993927 0.506073 0.493927 Pt\n0.006073 0.006073 0.006073 Pt\n",
"nsites": 12,
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"elements": [
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"Te",
"Pt"
],
"chemical_system": "Pt-Sb-Te",
"density": 9.979731283300982,
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"volume": 295.8062111956416,
"volume_molar": 14.844888679187015,
"formula_full": "Sb4 Te4 Pt4",
"formula_reduced": "SbTePt",
"formula_anonymous": "ABC",
"energy_above_hull": 1.3931050888888894,
"spacegroup": 198
}
]
}